Chemical Properties of 3-methylbutyl 3-(methylthio)propanoate

InChI

InChI=1S/C9H18O2S/c1-8(2)4-6-11-9(10)5-7-12-3/h8H,4-7H2,1-3H3

InChI Key

UUBYGRBYGZQQQG-UHFFFAOYSA-N

Formula

C9H18O2S

SMILES

CSCCC(=O)OCCC(C)C

Molecular Weight¹

190.30

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fG° : Standard Gibbs free energy of formation (kJ/mol).
• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• P_c : Critical Pressure (kPa).
• I : Polar retention indices.
• T_boil : Normal Boiling Point Temperature (K).
• T_c : Critical Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• V_c : Critical Volume (m³/kmol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[378.02; 453.44]	J/mol×K	[549.95; 745.63]
Cp,gas	378.02	J/mol×K	549.95	Joback Calculated Property
Cp,gas	392.14	J/mol×K	582.56	Joback Calculated Property
Cp,gas	405.64	J/mol×K	615.18	Joback Calculated Property
Cp,gas	418.52	J/mol×K	647.79	Joback Calculated Property
Cp,gas	430.78	J/mol×K	680.40	Joback Calculated Property
Cp,gas	442.42	J/mol×K	713.02	Joback Calculated Property
Cp,gas	453.44	J/mol×K	745.63	Joback Calculated Property

Similar Compounds

Find more compounds similar to 3-methylbutyl 3-(methylthio)propanoate.

Sources

• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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